D473-1509 Screening compound: 2-chloro-N~1~-(1H-indazol-6-yl)-4-(4-methyl-1,1,3-trioxotetrahydro-2H-1lambda~6~-isothiazol-2-yl)benzamide

D473-1509 Screening compound: 2-chloro-N~1~-(1H-indazol-6-yl)-4-(4-methyl-1,1,3-trioxotetrahydro-2H-1lambda~6~-isothiazol-2-yl)benzamide
D473-1509 Screening compound: 2-chloro-N~1~-(1H-indazol-6-yl)-4-(4-methyl-1,1,3-trioxotetrahydro-2H-1lambda~6~-isothiazol-2-yl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D473-1509
2-chloro-N~1~-(1H-indazol-6-yl)-4-(4-methyl-1,1,3-trioxotetrahydro-2H-1lambda~6~-isothiazol-2-yl)benzamide

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

D473-1509

Molecular Formula

C18H15ClN4O4S (C18 H15 ClN4 O4 S)

Compound Name

2-chloro-N~1~-(1H-indazol-6-yl)-4-(4-methyl-1,1,3-trioxotetrahydro-2H-1lambda~6~-isothiazol-2-yl)benzamide

IUPAC name

2-chloro-N-(1H-indazol-6-yl)-4-(4-methyl-113-trioxo-1lambda62-thiazolidin-2-yl)benzamide

SMILES

CC(CS(N1c(cc2)cc(Cl)c2C(Nc2cc([nH]nc3)c3cc2)=O)(=O)=O)C1=O

InChI

InChI=1S/C18H15ClN4O4S/c1-10-9-28(26,27)23(18(10)25)13-4-5-14(15(19)7-13)17(24)21-12-3-2-11-8-20-22-16(11)6-12/h2-8,10H,9H2,1H3,(H,20,22)(H,21,24)/t10-/m1/s1

InChI Key

GZLGRZFDHRYEQC-SNVBAGLBSA-N

MDL Number (MFCD)

MFCD10089900

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

418.86

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.155

Distribution Coefficient, logD

2.141

Water Solubility, LogSw

-3.42

Polar Surface Area

91.875

Acid Dissociation Constant (pKa)

8.86

Base Dissociation Constant (pKb)

1.76

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

16.70

D473-1509 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Nucleic Acid Ligands (8311 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Nervous system
  • Hemic and lymphatic
  • Immune system

References: we are preparing a list of scientific research reports with D473-1509 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D473-1509?
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What is the minimum amount of D473-1509 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D473-1509
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D473-1509
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of D473-1509 available by request